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CHEBI:179098 - PE(17:0/17:2(9Z,12Z))

ChEBI IDCHEBI:179098
ChEBI NamePE(17:0/17:2(9Z,12Z))
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FormulaC39H74NO8P
Net Charge0
Average Mass715.994
Monoisotopic Mass715.51520
SMILESCCCC/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COP(=O)(O)OCCN
InChIInChI=1S/C39H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h10,12,16,18,37H,3-9,11,13-15,17,19-36,40H2,1-2H3,(H,43,44)/b12-10-,18-16-/t37-/m1/s1
InChIKeySDVNIEVKUKQDTR-FHJINMDNSA-N
ChEBI Ontology
Outgoing Relation(s)
PE(17:0/17:2(9Z,12Z)) (CHEBI:179098) is a 1,2-diacyl-sn-glycero-3-phosphoethanolamine (CHEBI:64674)
IUPAC Name 
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxypropyl] heptadecanoate
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